BDBM50128465 (S)-2-{[1-((R)-2-Amino-3-mercapto-propionyl)-4-phenyl-piperidine-4-carbonyl]-amino}-4-methyl-pentanoic acid methyl ester::CHEMBL60804

SMILES: COC(=O)[C@H](CC(C)C)NC(=O)C1(CCN(CC1)C(=O)[C@@H](N)CS)c1ccccc1

InChI Key: InChIKey=QMCCVNYWKLFKCQ-ROUUACIJSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50128465   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Geranylgeranyl transferase type I beta subunit/Protein Farnesyltransferase (PFT) (Homo sapiens (Human))	BDBM50128465 ((S)-2-{[1-((R)-2-Amino-3-mercapto-propionyl)-4-phe...) Show SMILES COC(=O)[C@H](CC(C)C)NC(=O)C1(CCN(CC1)C(=O)[C@@H](N)CS)c1ccccc1 Show InChI InChI=1S/C22H33N3O4S/c1-15(2)13-18(20(27)29-3)24-21(28)22(16-7-5-4-6-8-16)9-11-25(12-10-22)19(26)17(23)14-30/h4-8,15,17-18,30H,9-14,23H2,1-3H3,(H,24,28)/t17-,18-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
GPC Biotech, Inc. Curated by ChEMBL					Assay Description Inhibition of Candida albicans Geranylgeranyl transferase type I				Bioorg Med Chem Lett 13: 1935-7 (2003) BindingDB Entry DOI: 10.7270/Q2SN08CJ
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